basic_info |
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Product_Name: | 6,6-DIBROMOPENICILLANIC ACID 1,1-DIOXIDE |
CAS: | 76646-91-8 |
EnglishSynonyms: | 6,6-DIBROMOPENICILLANIC ACID 1,1-DIOXIDE ; (2S,5R)-6,6-DIBROMO-3,3-DIMETHYL-4,4,7-TRIOXO-LAMBDA6-THIA-1-AZA-BICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID ; 6,6-DIBROMOPENICILLANIC ACID SULPHONE |
pro_mdlNumber: | MFCD11558954 |
pro_acceptors: | 6 |
pro_donors: | 1 |
pro_smile: | CC1([C@@H](N2[C@H](S1(=O)=O)C(C2=O)(Br)Br)C(=O)O)C |
InChi: | InChI=1S/C8H9Br2NO5S/c1-7(2)3(4(12)13)11-5(14)8(9,10)6(11)17(7,15)16/h3,6H,1-2H3,(H,12,13)/t3-,6+/m0/s1 |
InChiKey: | InChIKey=DZYBRGUNKNPEKM-BBIVZNJYSA-N |
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